4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=96.22918508058336 stress="-10.007344348968378 0.7227775462852917 3.4177021395516247 0.7227775462852917 -8.260170357094246 2.014881349382342 3.4177021395516247 2.014881349382342 -13.014948044375872" pbc="F F T" W 0.29874826 0.05835534 -0.25354363 -103.03341246 -80.70386264 62.51984769 W 1.48193431 1.42001865 0.20070203 94.35348521 79.80081415 -53.67457022 W 1.20342959 0.28187239 1.51001192 145.47226622 -103.25254606 -27.69638295 W 0.10170120 1.37793365 1.21904386 -136.79233897 104.15559455 18.85110548